2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one

C13H24N2O2 — CID 113395322

IUPAC2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one
SMILESCC(OC1CCCCC1N)C(=O)N1CCCC1
InChIInChI=1S/C13H24N2O2/c1-10(13(16)15-8-4-5-9-15)17-12-7-3-2-6-11(12)14/h10-12H,2-9,14H2,1H3
InChIKeyAKMDELHZLHAOSC-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.28
Rot. Bonds3

About 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one

2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one (PubChem CID 113395322) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one.

Molecular Properties

Compound Name2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one
PubChem CID113395322
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one
SMILESCC(OC1CCCCC1N)C(=O)N1CCCC1
InChIInChI=1S/C13H24N2O2/c1-10(13(16)15-8-4-5-9-15)17-12-7-3-2-6-11(12)14/h10-12H,2-9,14H2,1H3
InChIKeyAKMDELHZLHAOSC-UHFFFAOYSA-N
XLogP1.28
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-aminocyclopentyl)oxy-1-(azepan-1-yl)propan-1-one
CID 79465466
ethyl 2-(2-aminocyclohexyl)oxypropanoate
CID 106940844
(3R)-1-[(2R)-2-cycloheptyloxypropanoyl]pyrrolidine-3-carboxylic acid
CID 124689424
2-[(3S)-piperidin-3-yl]oxy-1-pyrrolidin-1-ylpropan-1-one
CID 66246383
2-cyclohexyloxy-1-piperazin-1-ylpropan-1-one
CID 82511384
cis-(1S,2R)-2-propan-2-yloxycycloheptan-1-amine
CID 94519420
[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl] acetate
CID 168848786
[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl] 2-bromo-3-cyclopropylpropanoate
CID 58339724
2-amino-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)cyclopentane-1-carboxamide
CID 112701757
(2-aminocyclopentyl) 2-methylpropanoate
CID 162779526
2-(4-amino-3-ethylpiperidin-1-yl)-1-pyrrolidin-1-ylpropan-1-one
CID 81459438
(2R)-1-morpholin-4-yl-2-[(2R)-oxan-2-yl]oxypropan-1-one
CID 92982714

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one?
The IUPAC name of 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one (CID 113395322) is 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one.
What is the SMILES notation for 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one?
The canonical SMILES for 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one is CC(OC1CCCCC1N)C(=O)N1CCCC1.
What is the InChIKey of 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one?
The InChIKey is AKMDELHZLHAOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10(13(16)15-8-4-5-9-15)17-12-7-3-2-6-11(12)14/h10-12H,2-9,14H2,1H3.
What are the key properties of 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one?
2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one has a molecular weight of 240.35 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminocyclohexyl)oxy-1-pyrrolidin-1-ylpropan-1-one is sourced from PubChem (CID 113395322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).